dc.creatorGonzalez, MP
dc.creatorMoldes, MDT
dc.creatorFall, Y
dc.creatorDias, LC
dc.creatorHelguera, AM
dc.date2005
dc.date47178
dc.date2014-11-16T22:34:10Z
dc.date2015-11-26T16:25:47Z
dc.date2014-11-16T22:34:10Z
dc.date2015-11-26T16:25:47Z
dc.date.accessioned2018-03-28T23:06:31Z
dc.date.available2018-03-28T23:06:31Z
dc.identifierPolymer. Elsevier Sci Ltd, v. 46, n. 8, n. 2783, n. 2790, 2005.
dc.identifier0032-3861
dc.identifierWOS:000227915800039
dc.identifier10.1016/j.polymer.2005.01.064
dc.identifierhttp://www.repositorio.unicamp.br/jspui/handle/REPOSIP/53929
dc.identifierhttp://www.repositorio.unicamp.br/handle/REPOSIP/53929
dc.identifierhttp://repositorio.unicamp.br/jspui/handle/REPOSIP/53929
dc.identifier.urihttp://repositorioslatinoamericanos.uchile.cl/handle/2250/1268707
dc.descriptionThe topological sub-structural molecular design (TOPS-MODE) approach has been applied to the study of mutagenic properties in a heterogeneous set of dental monomers. A model able to describe close to 90% of the experimental variance in the values for mutagenic activity of 41 dental monomers through genetic algorithm was developed with the use of the mentioned approach. Also, a study for the determination of the optimal number of variables in the equation and potential outliers was carried out. Finally, the TOPS-MODE approach was used to derive the contribution of different fragments to the mutagenic activity. (c) 2005 Elsevier Ltd. All rights reserved.
dc.description46
dc.description8
dc.description2783
dc.description2790
dc.languageen
dc.publisherElsevier Sci Ltd
dc.publisherOxford
dc.publisherInglaterra
dc.relationPolymer
dc.relationPolymer
dc.rightsfechado
dc.rightshttp://www.elsevier.com/about/open-access/open-access-policies/article-posting-policy
dc.sourceWeb of Science
dc.subjectepoxides
dc.subjectmethacrylates
dc.subjectQSAR
dc.subjectEdge-adjacency Matrix
dc.subjectTops-mode
dc.subjectSpectral Moments
dc.subjectMolecular Graphs
dc.subjectBiological-activity
dc.subjectPrediction
dc.subjectCarcinogenicity
dc.subjectPermeability
dc.subjectDescriptors
dc.subjectToxicology
dc.titleA topological sub-structural approach to the mutagenic activity in dental monomers. 3. Heterogeneous set of compounds
dc.typeArtículos de revistas


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